Vitas-M small molecule compound
ethyl [(3-butyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]acetate
Catalog ID
STK547677
SMILES CCCCn1c(SCC(=O)OCC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C25H32N2O3S MW 440.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32N2O3S/c1-3-5-15-27-23(29)21-22(26-24(27)31-17-20(28)30-4-2)19-12-8-7-11-18(19)16-25(21)13-9-6-10-14-25/h7-8,11-12H,3-6,9-10,13-17H2,1-2H3InChIKey
PLGPSQDOMNVUKA-UHFFFAOYSA-NSynonyms
498569-95-2498569952
CCCCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCC(=O)OCC
ethyl((3butyl4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)acetate
ethyl2((3butyl4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)acetate
ETHYL2(3BUTYL4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLACETATE
InChI=1SC25H32N2O3Sc135152723(29)2122(2624(27)311720(28)3042)1912871118(19)1625(21)1396101425h781112H369101317H212H3
MFCD03302109
ZINC000002349953
ZINC02349953
ZINC2349953
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